3-[(2S)-1-oxidanylidene-1-(propylamino)propan-2-yl]sulfonylpropanoate

Systemtic Name: 3-[(2S)-1-oxidanylidene-1-(propylamino)propan-2-yl]sulfonylpropanoate Openeye Name: 3-[(1S)-1-methyl-2-oxo-2-(propylamino)ethyl]sulfonylpropanoate CAS Name: 3-[(2S)-1-oxo-1-(propylamino)propan-2-yl]sulfonylpropanoate IUPAC Name: 3-[(2S)-1-oxo-1-(propylamino)propan-2-yl]sulfonylpropanoate Traditional Name: 3-[(1S)-2-keto-1-methyl-2-(propylamino)ethyl]sulfonylpropionate Formula: C9H16NO5S- MolecularWeight: 250.29204

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C(C)S(=O)(=O)CCC(=O)[O-]

Isomeric SMILES

CCCNC(=O)[C@H](C)S(=O)(=O)CCC(=O)[O-]

InChI

InChI=1S/C9H17NO5S/c1-3-5-10-9(13)7(2)16(14,15)6-4-8(11)12/h7H,3-6H2,1-2H3,(H,10,13)(H,11,12)/p-1/t7-/m0/s1